(4-bromophenyl)methyl-methyl-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxo-ethyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[2-[[(1S,2S)-2-methylcyclohexyl]amino]-2-oxoethyl]azanium Traditional Name: (4-bromobenzyl)-[2-keto-2-[[(1S,2S)-2-methylcyclohexyl]amino]ethyl]-methyl-ammonium Formula: C17H26BrN2O+ MolecularWeight: 354.30514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)C[NH+](C)CC2=CC=C(C=C2)Br

InChI

InChI=1S/C17H25BrN2O/c1-13-5-3-4-6-16(13)19-17(21)12-20(2)11-14-7-9-15(18)10-8-14/h7-10,13,16H,3-6,11-12H2,1-2H3,(H,19,21)/p+1/t13-,16-/m0/s1